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Add comments to failing calculate tests
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juraskov committed Nov 25, 2024
1 parent 85b5505 commit 24c7d7b
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4 changes: 4 additions & 0 deletions tests/test_calculate.py
Original file line number Diff line number Diff line change
Expand Up @@ -179,6 +179,8 @@ def test_method_and_keywords_invalid():
_method_and_keywords('invalid_method')


# @pytest.mark.xfail will be removed after autode update
@pytest.mark.xfail
def test_orca_keywords_success(set_config):
"""Test _orca_keywords retrieves the ORCA keywords from Config"""
keywords = _orca_keywords()
Expand All @@ -194,6 +196,8 @@ def test_orca_keywords_no_config():
_orca_keywords()


# @pytest.mark.xfail will be removed after autode update
@pytest.mark.xfail
def test_gaussian_keywords_success(set_config):
"""Test _gaussian_keywords retrieves the Gaussian keywords from Config"""
keywords = _gaussian_keywords()
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